N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide

C20H25N5O3 — CID 166237380

IUPACN'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide
SMILESCNc1ccc(NC(=O)C(=O)NCC(c2ccccc2)N2CCOCC2)cn1
InChIInChI=1S/C20H25N5O3/c1-21-18-8-7-16(13-22-18)24-20(27)19(26)23-14-17(15-5-3-2-4-6-15)25-9-11-28-12-10-25/h2-8,13,17H,9-12,14H2,1H3,(H,21,22)(H,23,26)(H,24,27)
InChIKeyFKUJIWOJJJICTD-UHFFFAOYSA-N
MW383.45 g/mol
LogP1.25
Rot. Bonds6

About N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide

N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide (PubChem CID 166237380) has the molecular formula C20H25N5O3 and a molecular weight of 383.45 g/mol. Its IUPAC name is N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide.

Molecular Properties

Compound NameN'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide
PubChem CID166237380
Molecular FormulaC20H25N5O3
Molecular Weight383.45 g/mol
Exact Mass383.20
IUPAC NameN'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide
SMILESCNc1ccc(NC(=O)C(=O)NCC(c2ccccc2)N2CCOCC2)cn1
InChIInChI=1S/C20H25N5O3/c1-21-18-8-7-16(13-22-18)24-20(27)19(26)23-14-17(15-5-3-2-4-6-15)25-9-11-28-12-10-25/h2-8,13,17H,9-12,14H2,1H3,(H,21,22)(H,23,26)(H,24,27)
InChIKeyFKUJIWOJJJICTD-UHFFFAOYSA-N
XLogP1.25
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide with MolForge

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Related Compounds

N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)oxamide
CID 166401105
N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide
CID 92680930
N'-(6-methoxy-3-pyridinyl)-N-[(2R)-2-(4-methylpiperazin-1-yl)-2-phenylethyl]oxamide
CID 51971264
2-(methylamino)-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]-1,3-thiazole-5-carboxamide
CID 97329336
4-[[2-[[2-(furan-2-yl)-2-morpholin-4-ylethyl]amino]-2-oxoacetyl]amino]benzoic acid
CID 52996641
N'-(4-aminophenyl)-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]oxamide
CID 166237377
N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ylethyl]-N'-phenyloxamide
CID 7285765
N'-(4-chlorophenyl)-N-[2-[4-(dimethylamino)phenyl]-2-morpholin-4-ylethyl]oxamide
CID 18583635
N-benzyl-N'-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]oxamide
CID 30835176
1-[(2S)-2-morpholin-4-yl-2-phenylethyl]-3-[(1R)-1-phenylethyl]urea
CID 51934988
N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]oxamide
CID 30835218
N-benzyl-N'-(2-morpholin-4-yl-2-pyridin-3-ylethyl)oxamide
CID 22517260

Frequently Asked Questions

What is the IUPAC name of N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide?
The IUPAC name of N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide (CID 166237380) is N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide.
What is the SMILES notation for N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide?
The canonical SMILES for N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide is CNc1ccc(NC(=O)C(=O)NCC(c2ccccc2)N2CCOCC2)cn1.
What is the InChIKey of N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide?
The InChIKey is FKUJIWOJJJICTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O3/c1-21-18-8-7-16(13-22-18)24-20(27)19(26)23-14-17(15-5-3-2-4-6-15)25-9-11-28-12-10-25/h2-8,13,17H,9-12,14H2,1H3,(H,21,22)(H,23,26)(H,24,27).
What are the key properties of N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide?
N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide has a molecular weight of 383.45 g/mol, XLogP of 1.25, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-phenylethyl)oxamide is sourced from PubChem (CID 166237380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).